2-[(5-bromanyl-4-nitro-1H-imidazol-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(5-bromanyl-4-nitro-1H-imidazol-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(5-bromo-4-nitro-1H-imidazol-2-yl)sulfanyl]acetic acid CAS Name: 2-[(5-bromo-4-nitro-1H-imidazol-2-yl)thio]acetic acid IUPAC Name: 2-[(5-bromo-4-nitro-1H-imidazol-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(5-bromo-4-nitro-1H-imidazol-2-yl)thio]acetic acid Formula: C5H4BrN3O4S MolecularWeight: 282.07196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)SC1=NC(=C(N1)Br)[N+](=O)[O-]

Isomeric SMILES

C(C(=O)O)SC1=NC(=C(N1)Br)[N+](=O)[O-]

InChI

InChI=1S/C5H4BrN3O4S/c6-3-4(9(12)13)8-5(7-3)14-1-2(10)11/h1H2,(H,7,8)(H,10,11)